[4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2-oxidanylidene-chromen-7-yl] benzoate

Systemtic Name: [4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2-oxidanylidene-chromen-7-yl] benzoate Openeye Name: [4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2-oxo-chromen-7-yl] benzoate CAS Name: benzoic acid [4-methyl-8-[(4-methyl-1-piperazinyl)methyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2-oxochromen-7-yl] benzoate Traditional Name: benzoic acid [2-keto-4-methyl-8-[(4-methylpiperazino)methyl]chromen-7-yl] ester Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2CN3CCN(CC3)C)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2CN3CCN(CC3)C)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H24N2O4/c1-16-14-21(26)29-22-18(16)8-9-20(28-23(27)17-6-4-3-5-7-17)19(22)15-25-12-10-24(2)11-13-25/h3-9,14H,10-13,15H2,1-2H3